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Browsing University of Hertfordshire by Author "Kalinić, Marko"
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Prediction of aqueous solubility of drug-like molecules using a novel algorithm for automatic adjustment of relative importance of descriptors implemented in counter-propagation artificial neural networks
Erić, Slavica; Kalinić, Marko; Popović, Aleksandar; Zloh, Mire; Kuzmanovski, Igor (2012)In this work, we present a novel approach for the development of models for prediction of aqueous solubility, based on the implementation of an algorithm for the automatic adjustment of descriptor's relative importance ... -
Structural insights into binding of small molecule inhibitors to Enhancer of Zeste Homolog 2
Kalinić, Marko; Zloh, Mire; Erić, Slavica (2014-11)Enhancer of Zeste Homolog 2 (EZH2) is a SET domain protein lysine methyltransferase (PKMT) which has recently emerged as a chemically tractable and therapeutically promising epigenetic target, evidenced by the discovery ...